Vitas-M small molecule compound

5-{[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonyl}-2-(4-methylphenyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK771708
SMILES Cc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)N1CCN(CC1)c1ccc(c(c1)Cl)Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H21Cl2N3O3 MW 494.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21Cl2N3O3/c1-16-2-5-18(6-3-16)31-25(33)20-8-4-17(14-21(20)26(31)34)24(32)30-12-10-29(11-13-30)19-7-9-22(27)23(28)15-19/h2-9,14-15H,10-13H2,1H3
InChIKey
IIBMYGWTCNTEAB-UHFFFAOYSA-N
Synonyms

5((4(34DICHLOROPHENYL)1PIPERAZINYL)CARBONYL)2(4METHYLPHENYL)1HISOINDOLE13(2H)DIONE
5((4(34dichlorophenyl)piperazin1yl)carbonyl)2(4methylphenyl)1Hisoindole13(2H)dione
5(4(34DICHLOROPHENYL)PIPERAZINE1CARBONYL)2(4METHYLPHENYL)ISOINDOLE13DIONE
CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC(=C(C=C5)Cl)Cl
InChI=1SC26H21Cl2N3O3c1162518(6316)3125(33)208417(1421(20)26(31)34)24(32)30121029(111330)197922(27)23(28)1519h291415H1013H21H3
MFCD03767490
ZINC000000644619
ZINC00644619
ZINC644619

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.